Compound Identification
SMILES
[Br-].CN(C)CCCOC1(CC2=CC=CC=C2)CCCCCC1.C[N+]1(C)C2CCC1CC(C2)OC(=O)C1C2=CC=CC=C2OC2=CC=CC=C12
InChIKey
InChIKey=ILCGVXSFEKMTCJ-UHFFFAOYSA-M
Formula
C42H57BrN2O4
Mass
733.832
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
-
Subclass
1-benzopyrans
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Level 5
Dibenzopyrans
- Level 6 Xanthenes
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Level 5
Dibenzopyrans
-
Subclass
1-benzopyrans
-
Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans
Direct Parent
Xanthenes
Alternative Parents
Diarylethers Tropane alkaloids Piperidines N-alkylpyrrolidines Benzene and substituted derivatives Tetraalkylammonium salts Trialkylamines Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic zwitterions Organic oxides Organic bromide salts Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Xanthene - Diaryl ether - Tropane alkaloid - Benzenoid - N-alkylpyrrolidine - Piperidine - Monocyclic benzene moiety - Tetraalkylammonium salt - Quaternary ammonium salt - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic bromide salt - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.
External Descriptors
Not available